Molecule

Erysovine

AlkaPlorer ID: AK009338

Synonym: None

IUPAC Name: (2R,13bS)-2,11-dimethoxy-2,6,8,9-tetrahydro-1H-indolo[7a,1-a]isoquinolin-12-ol

Structure

SMILES: COC1=C(O)C=C2C(=C1)CCN1CC=C3C=C[C@H](OC)C[C@]321

InChI: InChI=1S/C18H21NO3/c1-21-14-4-3-13-6-8-19-7-5-12-9-17(22-2)16(20)10-15(12)18(13,19)11-14/h3-4,6,9-10,14,20H,5,7-8,11H2,1-2H3/t14-,18-/m0/s1

InChIKey: IHPMURIXWRKEKD-KSSFIOAISA-N

Reference

Erythrina Alkaloids. XIV. Isolation and Characterization of Erysothiovine and Erysothiopine, New Alkaloids Containing Sulfur<sup>1a</sup>

PubChem CID: 5317203

LOTUS: LTS0148712

SuperNatural Ⅲ: SN0145868-01

NPASS: NPC133011

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Erythrina berteroana	Erythrina	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Erythrina salviiflora	Erythrina	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Erythrina folkersii	Erythrina	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Erythrina variegata	Erythrina	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Bulla gouldiana	Bulla	Bullidae	Cephalaspidea	Gastropoda	Mollusca	Metazoa	Eukaryota
Erythrina suberosa	Erythrina	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Erythrina arborescens	Erythrina	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota
Erythrina velutina	Erythrina	Fabaceae	Fabales	Magnoliopsida	Streptophyta	Viridiplantae	Eukaryota

Properties Information

Molecule Weight: 299.37000000000006

TPSA？: 41.93000000000001

MolLogP？: 2.3691000000000004

Number of H-Donors: 1

Number of H-Acceptors: 4

RingCount: 4

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi
Homo sapiens	Jurkat	IC50	14.2	ug.mL-1	10.1016/j.bmcl.2008.10.111
Homo sapiens	Jurkat	IC50	24.0	ug.mL-1	10.1016/j.bmcl.2008.10.111
Homo sapiens	MRC5	IC50	64000.0	nM	10.1016/j.ejmech.2022.114361
Plasmodium falciparum	Plasmodium falciparum	IC50	4100.0	nM	10.1016/j.ejmech.2022.114361